1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine

C16H23NO — CID 86814277

IUPAC1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine
SMILESCOc1ccccc1C1CCN(C2CCCC2)C1
InChIInChI=1S/C16H23NO/c1-18-16-9-5-4-8-15(16)13-10-11-17(12-13)14-6-2-3-7-14/h4-5,8-9,13-14H,2-3,6-7,10-12H2,1H3
InChIKeyYFALJFIVXVCSRL-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.43
Rot. Bonds3

About 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine

1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine (PubChem CID 86814277) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine.

Molecular Properties

Compound Name1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine
PubChem CID86814277
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine
SMILESCOc1ccccc1C1CCN(C2CCCC2)C1
InChIInChI=1S/C16H23NO/c1-18-16-9-5-4-8-15(16)13-10-11-17(12-13)14-6-2-3-7-14/h4-5,8-9,13-14H,2-3,6-7,10-12H2,1H3
InChIKeyYFALJFIVXVCSRL-UHFFFAOYSA-N
XLogP3.43
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxyphenyl)-1,2,3,5,6,7,8,8a-octahydroindolizine
CID 10308007
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CID 143500480
1-(3,4-diphenylcyclopentyl)-4-(2-methoxyphenyl)piperidine
CID 58772022
1-hydroxy-4-(2-methoxyphenyl)piperidine
CID 154170969
(3S)-1-cyclopentyl-3-phenylpyrrolidine
CID 97327940
2-[3-(2-methoxyphenyl)pyrrolidin-1-yl]ethanamine
CID 23287971
1-cyclopropyl-2-methoxybenzene;ethane
CID 144769798
(1-hydroxycyclopentyl)-[3-(2-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 111437303
(2-hydroxycyclopentyl)-[3-(2-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 110015914
4-(2-methoxyphenyl)-1-(4-methyl-9-bicyclo[5.4.1]dodecanyl)piperidine
CID 58772449
4-(2-methoxyphenyl)-1-[(3R)-2-methylpyrrolidin-3-yl]piperidine
CID 69237762
4-(2-methoxyphenyl)-1-propylpiperidine
CID 71653734

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine?
The IUPAC name of 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine (CID 86814277) is 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine.
What is the SMILES notation for 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine?
The canonical SMILES for 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine is COc1ccccc1C1CCN(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine?
The InChIKey is YFALJFIVXVCSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-18-16-9-5-4-8-15(16)13-10-11-17(12-13)14-6-2-3-7-14/h4-5,8-9,13-14H,2-3,6-7,10-12H2,1H3.
What are the key properties of 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine?
1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine has a molecular weight of 245.37 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2-methoxyphenyl)pyrrolidine is sourced from PubChem (CID 86814277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).